D02SME 03060901052D 1 1.00000 0.00000 0 94101 0 0 0 999 V2000 4.9542 -4.1875 0.0000 Fe 0 2 0 0 0 0 0 0 0 5.6625 -4.1875 0.0000 Cl 0 0 0 0 0 0 0 0 0 1.6792 -6.8750 0.0000 Cl 0 5 0 0 0 0 0 0 0 7.5661 -2.2916 0.0000 N 0 3 0 0 0 0 0 0 0 7.9447 -2.8903 0.0000 C 0 0 0 0 0 0 0 0 0 8.6524 -2.8616 0.0000 C 0 0 0 0 0 0 0 0 0 8.9785 -2.2339 0.0000 C 0 0 0 0 0 0 0 0 0 9.6856 -2.2050 0.0000 C 0 0 0 0 0 0 0 0 0 10.0650 -2.8041 0.0000 C 0 0 0 0 0 0 0 0 0 9.7321 -3.4334 0.0000 C 0 0 0 0 0 0 0 0 0 9.0260 -3.4593 0.0000 C 0 0 0 0 0 0 0 0 0 10.7728 -2.7765 0.0000 C 0 0 0 0 0 0 0 0 0 11.1027 -2.1497 0.0000 O 0 0 0 0 0 0 0 0 0 11.1506 -3.3756 0.0000 O 0 0 0 0 0 0 0 0 0 2.9813 -2.3166 0.0000 N 0 3 0 0 0 0 0 0 0 2.6246 -2.9285 0.0000 C 0 0 0 0 0 0 0 0 0 1.9163 -2.9255 0.0000 C 0 0 0 0 0 0 0 0 0 1.5677 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0.8600 -2.3067 0.0000 C 0 0 0 0 0 0 0 0 0 0.5026 -2.9191 0.0000 C 0 0 0 0 0 0 0 0 0 0.8581 -3.5360 0.0000 C 0 0 0 0 0 0 0 0 0 1.5646 -3.5363 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2057 -2.9171 0.0000 C 0 0 0 0 0 0 0 0 0 -0.5581 -2.3027 0.0000 O 0 0 0 0 0 0 0 0 0 -0.5616 -3.5295 0.0000 O 0 0 0 0 0 0 0 0 0 3.0592 -5.9626 0.0000 N 0 3 0 0 0 0 0 0 0 2.6845 -5.3616 0.0000 C 0 0 0 0 0 0 0 0 0 1.9765 -5.3857 0.0000 C 0 0 0 0 0 0 0 0 0 1.6464 -6.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0.9392 -6.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0.5636 -5.4343 0.0000 C 0 0 0 0 0 0 0 0 0 0.9005 -4.8071 0.0000 C 0 0 0 0 0 0 0 0 0 1.6067 -4.7857 0.0000 C 0 0 0 0 0 0 0 0 0 -0.1443 -5.4574 0.0000 C 0 0 0 0 0 0 0 0 0 -0.4782 -6.0821 0.0000 O 0 0 0 0 0 0 0 0 0 -0.5183 -4.8559 0.0000 O 0 0 0 0 0 0 0 0 0 7.6372 -5.8976 0.0000 N 0 3 0 0 0 0 0 0 0 7.9778 -5.2765 0.0000 C 0 0 0 0 0 0 0 0 0 8.6859 -5.2609 0.0000 C 0 0 0 0 0 0 0 0 0 9.0234 -4.6409 0.0000 C 0 0 0 0 0 0 0 0 0 9.7309 -4.6250 0.0000 C 0 0 0 0 0 0 0 0 0 10.0993 -5.2309 0.0000 C 0 0 0 0 0 0 0 0 0 9.7549 -5.8541 0.0000 C 0 0 0 0 0 0 0 0 0 9.0486 -5.8670 0.0000 C 0 0 0 0 0 0 0 0 0 10.8074 -5.2162 0.0000 C 0 0 0 0 0 0 0 0 0 11.1488 -4.5955 0.0000 O 0 0 0 0 0 0 0 0 0 11.1743 -5.8221 0.0000 O 0 0 0 0 0 0 0 0 0 6.3839 -4.1034 0.0000 N 0 5 0 0 0 0 0 0 0 4.2140 -4.1736 0.0000 N 0 5 0 0 0 0 0 0 0 3.8559 -4.7120 0.0000 C 0 0 0 0 0 0 0 0 0 6.7699 -3.5384 0.0000 C 0 0 0 0 0 0 0 0 0 6.7898 -4.6555 0.0000 C 0 0 0 0 0 0 0 0 0 3.8285 -3.6162 0.0000 C 0 0 0 0 0 0 0 0 0 5.9150 -5.5523 0.0000 C 0 0 0 0 0 0 0 0 0 5.8532 -2.6854 0.0000 C 0 0 0 0 0 0 0 0 0 3.1799 -4.5316 0.0000 C 0 0 0 0 0 0 0 0 0 4.7722 -5.5568 0.0000 C 0 0 0 0 0 0 0 0 0 4.7114 -2.7106 0.0000 C 0 0 0 0 0 0 0 0 0 6.4979 -2.9090 0.0000 C 0 0 0 0 0 0 0 0 0 6.5746 -5.2998 0.0000 C 0 0 0 0 0 0 0 0 0 7.4509 -3.7354 0.0000 C 0 0 0 0 0 0 0 0 0 4.1200 -5.3502 0.0000 C 0 0 0 0 0 0 0 0 0 4.0341 -2.9391 0.0000 C 0 0 0 0 0 0 0 0 0 5.3368 -5.1503 0.0000 N 0 0 0 0 0 0 0 0 0 5.2896 -3.1127 0.0000 N 0 0 0 0 0 0 0 0 0 3.1635 -3.8399 0.0000 C 0 0 0 0 0 0 0 0 0 7.4596 -4.4400 0.0000 C 0 0 0 0 0 0 0 0 0 5.0136 -6.2461 0.0000 C 0 0 0 0 0 0 0 0 0 4.9210 -2.0332 0.0000 C 0 0 0 0 0 0 0 0 0 5.7177 -6.2251 0.0000 C 0 0 0 0 0 0 0 0 0 5.6543 -2.0150 0.0000 C 0 0 0 0 0 0 0 0 0 6.9349 -5.9075 0.0000 C 0 0 0 0 0 0 0 0 0 3.7683 -5.9633 0.0000 C 0 0 0 0 0 0 0 0 0 6.8526 -2.2911 0.0000 C 0 0 0 0 0 0 0 0 0 3.6861 -2.3219 0.0000 C 0 0 0 0 0 0 0 0 0 6.5861 -6.5229 0.0000 C 0 0 0 0 0 0 0 0 0 6.9458 -7.1303 0.0000 C 0 0 0 0 0 0 0 0 0 7.6530 -7.1225 0.0000 C 0 0 0 0 0 0 0 0 0 7.9990 -6.5024 0.0000 C 0 0 0 0 0 0 0 0 0 2.7090 -6.5753 0.0000 C 0 0 0 0 0 0 0 0 0 3.0641 -7.1872 0.0000 C 0 0 0 0 0 0 0 0 0 3.7746 -7.1830 0.0000 C 0 0 0 0 0 0 0 0 0 4.1230 -6.5701 0.0000 C 0 0 0 0 0 0 0 0 0 4.0490 -1.7122 0.0000 C 0 0 0 0 0 0 0 0 0 3.7015 -1.0954 0.0000 C 0 0 0 0 0 0 0 0 0 2.9922 -1.0879 0.0000 C 0 0 0 0 0 0 0 0 0 2.6318 -1.7023 0.0000 C 0 0 0 0 0 0 0 0 0 7.9206 -1.6744 0.0000 C 0 0 0 0 0 0 0 0 0 7.5627 -1.0574 0.0000 C 0 0 0 0 0 0 0 0 0 6.8466 -1.0616 0.0000 C 0 0 0 0 0 0 0 0 0 6.4952 -1.6793 0.0000 C 0 0 0 0 0 0 0 0 0 1.0833 -1.4083 0.0000 Cl 0 5 0 0 0 0 0 0 0 8.7958 -1.3750 0.0000 Cl 0 5 0 0 0 0 0 0 0 8.6708 -6.7500 0.0000 Cl 0 5 0 0 0 0 0 0 0 42 45 1 0 0 0 45 46 1 0 0 0 45 47 2 0 0 0 20 23 1 0 0 0 23 24 2 0 0 0 23 25 1 0 0 0 9 12 1 0 0 0 12 13 2 0 0 0 12 14 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 6 7 2 0 0 0 7 8 1 0 0 0 8 9 2 0 0 0 26 27 1 0 0 0 27 28 1 0 0 0 28 29 2 0 0 0 29 30 1 0 0 0 30 31 2 0 0 0 31 32 1 0 0 0 32 33 2 0 0 0 33 28 1 0 0 0 31 34 1 0 0 0 34 35 2 0 0 0 34 36 1 0 0 0 9 10 1 0 0 0 10 11 2 0 0 0 11 6 1 0 0 0 15 16 1 0 0 0 16 17 1 0 0 0 17 18 2 0 0 0 18 19 1 0 0 0 19 20 2 0 0 0 20 21 1 0 0 0 21 22 2 0 0 0 22 17 1 0 0 0 37 38 1 0 0 0 38 39 1 0 0 0 39 40 2 0 0 0 40 41 1 0 0 0 41 42 2 0 0 0 42 43 1 0 0 0 43 44 2 0 0 0 44 39 1 0 0 0 85 86 2 0 0 0 64 54 1 0 0 0 86 87 1 0 0 0 65 55 1 0 0 0 87 15 2 0 0 0 15 75 1 0 0 0 66 53 1 0 0 0 74 4 2 0 0 0 67 52 2 0 0 0 4 88 1 0 0 0 68 70 2 0 0 0 88 89 2 0 0 0 69 71 2 0 0 0 89 90 1 0 0 0 70 54 1 0 0 0 90 91 2 0 0 0 91 74 1 0 0 0 71 55 1 0 0 0 61 67 1 0 0 0 56 66 2 0 0 0 57 64 2 0 0 0 58 65 2 0 0 0 57 68 1 0 0 0 58 69 1 0 0 0 60 72 1 0 0 0 62 73 1 0 0 0 59 74 1 0 0 0 50 49 1 0 0 0 63 75 1 0 0 0 51 48 1 0 0 0 72 76 2 0 0 0 52 48 1 0 0 0 76 77 1 0 0 0 53 49 1 0 0 0 77 78 2 0 0 0 54 60 2 0 0 0 78 79 1 0 0 0 55 59 2 0 0 0 79 37 2 0 0 0 37 72 1 0 0 0 56 50 1 0 0 0 73 26 2 0 0 0 57 62 1 0 0 0 26 80 1 0 0 0 58 63 1 0 0 0 80 81 2 0 0 0 59 51 1 0 0 0 81 82 1 0 0 0 60 52 1 0 0 0 82 83 2 0 0 0 83 73 1 0 0 0 61 51 2 0 0 0 75 84 2 0 0 0 62 50 2 0 0 0 84 85 1 0 0 0 63 53 2 0 0 0 1 2 1 0 0 0 M CHG 8 1 2 3 -1 4 1 15 1 26 1 37 1 48 -1 49 -1 M CHG 3 92 -1 93 -1 94 -1 M END $$$$